* LIGAND DATABASE FILE (OPLS2005)
*
001      67    69    119    189     345
    1     0 S   NP   _N1_     1    28.80779    94.73025   -23.50602
    2     1 S   H    _HN1     2     1.02824    29.74008   171.14497
    3     1 S   H    _H1_     3     1.02773   104.62911   -88.31865
    4     1 S   H    _H2_     4     1.03113    80.44496    18.18864
    5     1 S   CT   _CA1     5     1.50103   134.69564   127.71807
    6     5 S   HC   _HA1     6     1.09582   105.20464    80.59198
    7     5 S   CO3  _C1_     7     1.53783   112.48791   -39.46250
    8     7 S   O2Z  _O11     8     1.26338   115.07823   -43.66186
    9     7 S   O2Z  _O12     9     1.26239   114.92780   135.63072
   10     5 S   CT   _CB1    10     1.53087   107.40569  -161.67109
   11    10 S   HC   HB11    11     1.09833   109.28702   -52.39214
   12    10 S   HC   HB12    12     1.09664   110.41167    63.98212
   13    10 S   CT   _CG1    13     1.52972   112.80934  -173.52328
   14    13 S   HC   HG11    14     1.09585   110.62753   -65.06487
   15    13 S   HC   HG12    15     1.09667   109.76547    54.16517
   16    13 S   C    _CD1    16     1.51826   112.30280   174.76176
   17    16 S   O    _OE1    17     1.22736   123.26978     7.72217
   18    16 S   N    _N2_    18     1.38657   111.61540  -172.66321
   19    18 S   H    _HN2    19     1.01605   118.97232    -0.09279
   20    18 S   CT1  _CA2    20     1.46147   123.38675   176.83387
   21    20 S   HC   _HA2    21     1.09477   109.06193    -9.41254
   22    20 S   C    _C2_    22     1.53484   108.31031  -124.12004
   23    22 S   O    _O2_    23     1.23027   122.37616  -148.23826
   24    20 S   CT   _CB2    32     1.53333   111.86964   113.49286
   25    24 S   HC   HB21    33     1.09662   109.41684    58.25558
   26    24 S   HC   HB22    34     1.09526   111.26477   175.57004
   27    22 S   N    _N3_    24     1.38371   113.47003    39.32338
   28    27 S   H    _HN3    25     1.01635   119.48766    -3.54939
   29    24 S   S    _SG2    35     1.82754   114.08006   -61.07411
   30    27 S   CT   _CA3    26     1.45286   123.18097   176.96133
   31    30 S   HC   HA31    27     1.09550   107.55260   -63.54551
   32    30 S   HC   HA32    28     1.09557   107.93070    52.87844
   33    29 S   CT   _C18    36     1.83165   100.04923   -80.11961
   34    33 S   F    F4__    37     1.36521   108.31793   -58.33153
   35    33 S   F    F5__    38     1.36327   109.31341    55.56821
   36    30 S   CO3  _C3_    29     1.52947   114.08689   174.86722
   37    36 S   O2Z  _O31    30     1.26373   116.03960     0.12033
   38    36 S   O2Z  _O32    31     1.26424   114.42469  -179.83929
   39    33 S   CA   _C14    39     1.51016   110.29322   178.35694
   40    39 S   CA   _C15    40     1.39785   120.94317    99.06045
   41    40 S   HA   _H8_    41     1.08728   120.54324    -0.47642
   42    40 S   CA   _C16    42     1.39388   120.27612   179.40258
   43    42 S   HA   _H9_    43     1.08673   119.08653   179.50981
   44    42 S   CA   _C17    44     1.39827   120.12129     0.42197
   45    44 S   CA   _C12    45     1.40234   121.02585     0.12667
   46    44 S   OH   _O34    66     1.36972   118.72249   176.29118
   47    46 S   HO   _H10    67     0.97192   109.13288     5.08184
   48    39 S   CA   _C13    46     1.40577   120.08233   -81.08321
   49    48 S   HA   _H7_    47     1.08881   118.10192    -2.68919
   50    45 S   N    _N5_    48     1.41204   121.82607  -178.52355
   51    50 S   CA   _C6_    49     1.41270   124.82210  -139.74829
   52    50 S   C    _C11    60     1.43222   126.50721    42.45005
   53    52 S   O    _O33    61     1.22305   129.26367     0.35388
   54    51 S   CA   _C5_    50     1.38119   132.09991     6.31323
   55    54 S   HA   _H4_    51     1.08337   122.83196    -0.46646
   56    54 S   CA   _C4_    52     1.40058   117.80379   178.23786
   57    56 S   HA   _H3_    53     1.08808   118.66804  -179.74512
   58    56 S   CA   _C9_    54     1.41431   121.69773    -0.20748
   59    58 S   CA   _C8_    55     1.40054   119.72602    -1.63087
   60    59 S   HA   _H5_    56     1.08462   121.60129  -178.35503
   61    58 S   CT   _C10    62     1.50282   119.23894   179.26246
   62    61 S   F    F1__    63     1.36363   112.48379   -54.42226
   63    61 S   F    F2__    64     1.36096   112.58566    65.37753
   64    61 S   F    F3__    65     1.36229   113.70932  -174.30897
   65    51 S   CA   _C7_    57     1.39497   107.60733  -177.46595
   66    65 S   N    _N4_    58     1.39235   108.89350    -0.57403
   67    66 S   H    _H6_    59     1.01152   125.28370   179.84423
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   6   5   4   3
   9   4   3   2   1   1   9   8   4   7   3   8  11   3   1   4
   1  10  12   6   3   8   4   9   3   8   8   3   4   2   1   1
   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    45    48    49  
   35    39    40    48  
   39    40    48  
   37    38  
   38  
    0  
   40    41    42    43    44    45    48    49    50  
   41    42    43    44    45    48    49    46  
   42    43    44    48  
   43    44    45    48    50    46    47  
   44    45    46  
   45    48    49    50    51    52    46    47  
   48    49    50    51    54    65    66    52    53    46    47  
   47    48    50  
    0  
   49    50    51    52  
   50  
   51    54    55    56    59    65    66    67    52    53  
   54    55    56    57    58    59    60    65    66    67    52    53  
   53    54    59    65    66    67  
   65    66    67  
   55    56    57    58    59    65    66    61  
   56    57    58    65  
   57    58    59    60    65    61    62    63    64  
   58    59    61  
   59    60    65    66    61    62    63    64  
   60    65    66    67    61    62    63    64  
   65    66    61  
   62    63    64    65  
   63    64  
   64  
    0  
   66    67  
   67  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.2500   0.0620   0.407500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   35   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0700  -0.160000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.2500   0.1700  -0.292500   1.8100   1.6000   0.054801302  -1.445846770
   51   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.7500   0.1050   0.813700   1.9250   1.7000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.2500   0.0620   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
   63   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
   64   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
   65   3.5500   0.0700   0.106600   2.5000   1.7750   0.001000000  -0.843144165
   66   3.2500   0.1700  -0.472700   1.8100   1.6000   0.054801302  -1.445846770
   67   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   367.000  1.332
   33    35   367.000  1.332
   33    39   317.000  1.510
   39    40   469.000  1.400
   39    48   469.000  1.400
   40    41   367.000  1.080
   40    42   469.000  1.400
   42    43   367.000  1.080
   42    44   469.000  1.400
   44    45   469.000  1.400
   44    46   450.000  1.364
   45    48   469.000  1.400
   45    50   360.000  1.404
   48    49   367.000  1.080
   50    51   360.000  1.404
   50    52   490.000  1.335
   51    54   469.000  1.400
   51    65   469.000  1.400
   54    55   367.000  1.080
   54    56   469.000  1.400
   56    57   367.000  1.080
   56    58   469.000  1.400
   58    59   469.000  1.400
   58    61   317.000  1.510
   59    60   367.000  1.080
   59    65   469.000  1.400
   65    66   360.000  1.404
   66    67   434.000  1.010
   66    52   490.000  1.335
   52    53   570.000  1.229
   61    62   367.000  1.332
   61    63   367.000  1.332
   61    64   367.000  1.332
   46    47   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    90.00000  110.13500
   29    33    35    90.00000  110.13500
   29    33    39    80.00000  109.48900
   33    39    40    70.00000  120.00000
   33    39    48    70.00000  120.00000
   35    33    34    77.00000  109.10000
   39    33    34    50.00000  109.50000
   39    33    35    50.00000  109.50000
   39    40    41    35.00000  120.00000
   39    40    42    63.00000  120.00000
   39    48    45    63.00000  120.00000
   39    48    49    35.00000  120.00000
   40    42    43    35.00000  120.00000
   40    42    44    63.00000  120.00000
   42    40    41    35.00000  120.00000
   42    44    45    63.00000  120.00000
   42    44    46    70.00000  120.00000
   44    42    43    35.00000  120.00000
   44    45    48    63.00000  120.00000
   44    45    50    70.00000  119.01900
   44    46    47    35.00000  113.00000
   45    48    49    35.00000  120.00000
   45    50    51    75.00000  115.74000
   45    50    52    65.00000  121.96500
   48    39    40    63.00000  120.00000
   50    45    48    70.00000  119.01900
   50    51    54    70.00000  119.01900
   50    51    65    70.00000  119.01900
   50    52    66    90.00000  111.91700
   50    52    53    80.00000  122.90000
   51    54    55    35.00000  120.00000
   51    54    56    63.00000  120.00000
   51    65    59    63.00000  120.00000
   51    65    66    70.00000  119.01900
   54    56    57    35.00000  120.00000
   54    56    58    63.00000  120.00000
   56    54    55    35.00000  120.00000
   56    58    59    63.00000  120.00000
   56    58    61    70.00000  120.00000
   58    56    57    35.00000  120.00000
   58    59    60    35.00000  120.00000
   58    59    65    63.00000  120.00000
   58    61    62    50.00000  109.50000
   58    61    63    50.00000  109.50000
   58    61    64    50.00000  109.50000
   59    65    66    70.00000  119.01900
   65    51    54    63.00000  120.00000
   65    59    60    35.00000  120.00000
   65    66    67    45.00000  118.23600
   65    66    52    65.00000  121.96500
   66    52    53    80.00000  122.90000
   52    50    51    65.00000  121.96500
   52    66    67    35.00000  119.80000
   61    58    59    70.00000  120.00000
   63    61    62    77.00000  109.10000
   64    61    62    77.00000  109.10000
   64    61    63    77.00000  109.10000
   46    44    45    70.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    36    37   0.00000  1.0 1.0
   27    30    36    38   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.01700  1.0 1.0
   24    29    33    35  -0.23550 -1.0 2.0
   24    29    33    35   0.21350  1.0 3.0
   24    29    33    39  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40  -0.16000  1.0 1.0
   29    33    39    40  -0.03200 -1.0 2.0
   29    33    39    40   0.04500  1.0 3.0
   29    33    39    48  -0.16000  1.0 1.0
   29    33    39    48  -0.03200 -1.0 2.0
   29    33    39    48   0.04500  1.0 3.0
   33    39    40    41   3.62500 -1.0 2.0
   33    39    40    42   3.62500 -1.0 2.0
   33    39    48    45   3.62500 -1.0 2.0
   33    39    48    49   3.62500 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    48   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    48   0.00000  1.0 1.0
   39    40    42    43   3.62500 -1.0 2.0
   39    40    42    44   3.62500 -1.0 2.0
   40    39    48    45   3.62500 -1.0 2.0
   40    39    48    49   3.62500 -1.0 2.0
   40    42   -44    45   3.62500 -1.0 2.0
   40    42    44    46   3.62500 -1.0 2.0
   41    40    42    43   3.62500 -1.0 2.0
   41    40    42    44   3.62500 -1.0 2.0
   42    44    45    48   3.62500 -1.0 2.0
   42    44    45    50   3.62500 -1.0 2.0
   42    44    46    47   0.84100 -1.0 2.0
   43    42    44    45   3.62500 -1.0 2.0
   43    42    44    46   3.62500 -1.0 2.0
   44    45   -48    39   3.62500 -1.0 2.0
   44    45    48    49   3.62500 -1.0 2.0
   44    45    50    51   0.70250  1.0 1.0
   44    45    50    51   1.56150 -1.0 2.0
   44    45    50    52   1.00100  1.0 1.0
   44    45    50    52   0.85050 -1.0 2.0
   45    44    46    47   0.84100 -1.0 2.0
   45    50    51    54   0.70250  1.0 1.0
   45    50    51    54   1.56150 -1.0 2.0
   45    50    51    65   0.70250  1.0 1.0
   45    50    51    65   1.56150 -1.0 2.0
   45    50    52    66   0.54900  1.0 1.0
   45    50    52    66   1.90750 -1.0 2.0
   45    50    52    53   0.04000 -1.0 2.0
   48    39    40    41   3.62500 -1.0 2.0
   48    39   -40    42   3.62500 -1.0 2.0
   48    45    50    51   0.70250  1.0 1.0
   48    45    50    51   1.56150 -1.0 2.0
   48    45    50    52   1.00100  1.0 1.0
   48    45    50    52   0.85050 -1.0 2.0
   50    45    48    39   3.62500 -1.0 2.0
   50    45    48    49   3.62500 -1.0 2.0
   50    51    54    55   3.62500 -1.0 2.0
   50    51    54    56   3.62500 -1.0 2.0
   50    51    65    59   3.62500 -1.0 2.0
   50    51   -65    66   3.62500 -1.0 2.0
   51    50   -52    66   0.54900  1.0 1.0
   51    50   -52    66   1.90750 -1.0 2.0
   51    50    52    53   0.04000 -1.0 2.0
   51    54    56    57   3.62500 -1.0 2.0
   51    54    56    58   3.62500 -1.0 2.0
   51    65    66    67   0.97800 -1.0 2.0
   51    65   -66    52   1.00100  1.0 1.0
   51    65   -66    52   0.85050 -1.0 2.0
   54    51    65    59   3.62500 -1.0 2.0
   54    51    65    66   3.62500 -1.0 2.0
   54    56   -58    59   3.62500 -1.0 2.0
   54    56    58    61   3.62500 -1.0 2.0
   55    54    56    57   3.62500 -1.0 2.0
   55    54    56    58   3.62500 -1.0 2.0
   56    58    59    60   3.62500 -1.0 2.0
   56    58    59    65   3.62500 -1.0 2.0
   56    58    61    62   0.00000  1.0 1.0
   56    58    61    63   0.00000  1.0 1.0
   56    58    61    64   0.00000  1.0 1.0
   57    56    58    59   3.62500 -1.0 2.0
   57    56    58    61   3.62500 -1.0 2.0
   58    59   -65    51   3.62500 -1.0 2.0
   58    59    65    66   3.62500 -1.0 2.0
   59    58    61    62   0.00000  1.0 1.0
   59    58    61    63   0.00000  1.0 1.0
   59    58    61    64   0.00000  1.0 1.0
   59    65    66    67   0.97800 -1.0 2.0
   59    65    66    52   1.00100  1.0 1.0
   59    65    66    52   0.85050 -1.0 2.0
   60    59    65    51   3.62500 -1.0 2.0
   60    59    65    66   3.62500 -1.0 2.0
   65    51    54    55   3.62500 -1.0 2.0
   65    51   -54    56   3.62500 -1.0 2.0
   65    66   -52    50   0.54900  1.0 1.0
   65    66   -52    50   1.90750 -1.0 2.0
   65    66    52    53   0.04000 -1.0 2.0
   67    66    52    50   2.56700 -1.0 2.0
   67    66    52    53   2.45000 -1.0 2.0
   52    50    51    54   1.00100  1.0 1.0
   52    50    51    54   0.85050 -1.0 2.0
   52    50   -51    65   1.00100  1.0 1.0
   52    50   -51    65   0.85050 -1.0 2.0
   61    58    59    60   3.62500 -1.0 2.0
   61    58    59    65   3.62500 -1.0 2.0
   46    44    45    48   3.62500 -1.0 2.0
   46    44    45    50   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   40    48    39    33   4.00000 -1.0 2.0
   42    41    40    39   1.10000 -1.0 2.0
   44    43    42    40   1.10000 -1.0 2.0
   45    46    44    42   4.00000 -1.0 2.0
   48    50    45    44   4.00000 -1.0 2.0
   45    49    48    39   1.10000 -1.0 2.0
   51    52    50    45   1.00000 -1.0 2.0
   54    65    51    50   4.00000 -1.0 2.0
   56    55    54    51   1.10000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   59    61    58    56   4.00000 -1.0 2.0
   65    60    59    58   1.10000 -1.0 2.0
   59    66    65    51   4.00000 -1.0 2.0
   67    52    66    65   1.00000 -1.0 2.0
   50    66    52    53  10.50000 -1.0 2.0
END
